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Application

Discovery Studio 1.0 Materials Studio 0.16257398312555094 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.01594858367055463 Amorphous Cell 0.023803856224708403 Antibody 2.3803856224708403E-4 Blends 4.7607712449416806E-4 CASTEP 0.0937871935253511 CDOCKER 0.29873839562009047 CHARMm 0.35229707212568434 COMPASS 0.04784575101166389 COMPASS III 0.009997619614377529 COSMObase 7.141156867412521E-4 COSMOconf 0.00119019281123542 COSMOperm 0.0 COSMOtherm 0.018567007855272554 Catalyst 0.206855510592716 Classical Simulations 0.45560580814091883 Conformers 4.7607712449416806E-4 Crystallization 0.020233277791002143 DFTB Plus 2.3803856224708403E-4 DMol3 0.11425850987860034 DPD 2.3803856224708403E-4 Discover 4.7607712449416806E-4 Forcite 0.06903118305165437 GULP 0.0038086169959533444 LUDI 0.005236848369435849 LibDock 0.10854558438467031 LigandFit 0.019757200666507973 MCSS 0.0019043084979766722 MODELER 0.297548202808855 MesoDyn 2.3803856224708403E-4 Mesocite 7.141156867412521E-4 Mesoscale 0.00119019281123542 Morphology 0.0021423470602237563 ONETEP 2.3803856224708403E-4 Polymorph 0.0 QMERA 4.7607712449416806E-4 QSAR 9.521542489883361E-4 Quantum Mechanics 0.203999047845751 Reflex 0.017852892168531302 Semi-empirical 0.0014282313734825041 Sorption 0.004522732682694597 VAMP 2.3803856224708403E-4 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03332539871459177

Year

2015 0.0 2016 0.0 2017 0.09974025974025974 2018 0.22493506493506493 2019 0.3625974025974026 2020 0.3953246753246753 2021 0.4701298701298701 2022 0.6379220779220779 2023 0.8192207792207792 2024 1.0 2025 0.7911688311688312 2026 0.11324675324675325

Keywords

activity 1.0 target 0.9702945266085198 docking 0.4386297560358994 visualization 0.335355833649349 potential 0.3222095815952471 analysis 0.1858172165339401 novel 0.16938440146631273 binding 0.1484009606876501 vitro 0.11591454936164834 compound 0.09847048413601314 synthesis 0.0925293894577171 inhibition 0.09177095183921123 synthesized 0.0906332954114524 protein 0.0844393881936544 between 0.0583996966249526 promising 0.055997977499683986 silico 0.05334344583491341 active 0.04702313234736443 potent 0.04323094425483504 treatment 0.03223359878649981 drug 0.03210719251674883 development 0.017444065225635193 interaction 0.01731765895588421 enzyme 0.011376564277588168 mechanism 0.0
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